N-[2-(3-oxidanylidenebutanoylamino)-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: N-[2-(3-oxidanylidenebutanoylamino)-1,3-benzothiazol-6-yl]benzamide Openeye Name: N-[2-(3-oxobutanoylamino)-1,3-benzothiazol-6-yl]benzamide CAS Name: N-[2-(1,3-dioxobutylamino)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: N-[2-(3-oxobutanoylamino)-1,3-benzothiazol-6-yl]benzamide Traditional Name: N-[2-(acetoacetylamino)-1,3-benzothiazol-6-yl]benzamide Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)CC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H15N3O3S/c1-11(22)9-16(23)21-18-20-14-8-7-13(10-15(14)25-18)19-17(24)12-5-3-2-4-6-12/h2-8,10H,9H2,1H3,(H,19,24)(H,20,21,23)